UCSF

ZINC37594164

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 27th, 2009 7 Yes

Popular Name: Tetrahydro-2H-pyran-3-ol Tetrahydro-2H-pyran-3-ol

Find On: PubMed — Wikipedia — Google

CAS Numbers: 100937-76-6 , 19752-84-2 , 72886-97-6 , [19752-84-2]

Download: MOL2 SDF SMILES Flexibase

Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 0.06 -0.89 -3.37 1 2 0 29 102.133 0 ↓

Vendor Notes

Note Type Comments Provided By
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 95% Fluorochem
Purity 95+% Matrix Scientific
Purity 97% Fluorochem
PUBCHEM_PATENT_ID EP0039060A1; EP0117476A1; EP0188235A2; EP0188235B1; EP0227932A1; EP0227932B1; EP0263385A2; EP0263385B1; EP0375404A2; EP0375404B1; EP0524439A1; EP0525420A1; EP0525420B1; EP0580402A2; EP0580402A3; EP0625967B1; EP0660716A1; EP0763041A1; EP0858458A1; EP092420 IBM Patent Data
PUBCHEM_PATENT_ID EP1020445A1; WO2000035908A1 IBM Patent Data
Warnings IRRITANT Matrix Scientific
PUBCHEM_PATENT_ID US5786359 IBM Patent Data

Activity (Go SEA)

Analogs ( Draw Identity 99% 90% 80% 70% )